3-(6-ethyldecylsulfanyl)-2-methyl-propanoate

Systemtic Name: 3-(6-ethyldecylsulfanyl)-2-methyl-propanoate Openeye Name: 3-(6-ethyldecylsulfanyl)-2-methyl-propanoate CAS Name: 3-(6-ethyldecylthio)-2-methylpropanoate IUPAC Name: 3-(6-ethyldecylsulfanyl)-2-methylpropanoate Traditional Name: 3-(6-ethyldecylthio)-2-methyl-propionate Formula: C16H31O2S- MolecularWeight: 287.48114

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CCCCCSCC(C)C(=O)[O-]

Isomeric SMILES

CCCCC(CC)CCCCCSCC(C)C(=O)[O-]

InChI

InChI=1S/C16H32O2S/c1-4-6-10-15(5-2)11-8-7-9-12-19-13-14(3)16(17)18/h14-15H,4-13H2,1-3H3,(H,17,18)/p-1